3-[4-cyclopropyl-5-[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-cyclopropyl-5-[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[2-(methylcarbamoylamino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[[2-(methylcarbamoylamino)-2-oxoethyl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[2-(methylcarbamoylamino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[[2-keto-2-(methylcarbamoylamino)ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C12H18N6O3S MolecularWeight: 326.37472

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CSC1=NN=C(N1C2CC2)CCC(=O)N

Isomeric SMILES

CNC(=O)NC(=O)CSC1=NN=C(N1C2CC2)CCC(=O)N

InChI

InChI=1S/C12H18N6O3S/c1-14-11(21)15-10(20)6-22-12-17-16-9(5-4-8(13)19)18(12)7-2-3-7/h7H,2-6H2,1H3,(H2,13,19)(H2,14,15,20,21)